| SpectraBase Compound ID | 1IAUWccksYO |
|---|---|
| InChI | InChI=1S/C12H18O6/c1-11(2)15-7(5-13)9(17-11)10-8(6-14)16-12(3,4)18-10/h5-10H,1-4H3 |
| InChIKey | ZAKDWWRIHDUQNM-UHFFFAOYSA-N |
| Mol Weight | 258.27 g/mol |
| Molecular Formula | C12H18O6 |
| Exact Mass | 258.110338 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D3JiKUubmWo |
|---|---|
| Name | 2,3:4,5-di-o-Isopropylidene-L-manno-hexadialdose |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.110338294 u |
| Formula | C12H18O6 |
| InChI | InChI=1S/C12H18O6/c1-11(2)15-7(5-13)9(17-11)10-8(6-14)16-12(3,4)18-10/h5-10H,1-4H3 |
| InChIKey | ZAKDWWRIHDUQNM-UHFFFAOYSA-N |
| Molecular Weight | 258.270 g/mol |
| SMILES | C1(C2C(OC(O2)(C)C)C=O)C(OC(O1)(C)C)C=O |